2-(methylamino)-N-(oxan-4-yl)pyridine-4-sulfonamide

C11H17N3O3S — CID 62147724

IUPAC2-(methylamino)-N-(oxan-4-yl)pyridine-4-sulfonamide
SMILESCNc1cc(S(=O)(=O)NC2CCOCC2)ccn1
InChIInChI=1S/C11H17N3O3S/c1-12-11-8-10(2-5-13-11)18(15,16)14-9-3-6-17-7-4-9/h2,5,8-9,14H,3-4,6-7H2,1H3,(H,12,13)
InChIKeyKIIGQOGZZLKOHH-UHFFFAOYSA-N
MW271.34 g/mol
LogP0.58
Rot. Bonds4

About 2-(methylamino)-N-(oxan-4-yl)pyridine-4-sulfonamide

2-(methylamino)-N-(oxan-4-yl)pyridine-4-sulfonamide (PubChem CID 62147724) has the molecular formula C11H17N3O3S and a molecular weight of 271.34 g/mol. Its IUPAC name is 2-(methylamino)-N-(oxan-4-yl)pyridine-4-sulfonamide.

Molecular Properties

Compound Name2-(methylamino)-N-(oxan-4-yl)pyridine-4-sulfonamide
PubChem CID62147724
Molecular FormulaC11H17N3O3S
Molecular Weight271.34 g/mol
Exact Mass271.10
IUPAC Name2-(methylamino)-N-(oxan-4-yl)pyridine-4-sulfonamide
SMILESCNc1cc(S(=O)(=O)NC2CCOCC2)ccn1
InChIInChI=1S/C11H17N3O3S/c1-12-11-8-10(2-5-13-11)18(15,16)14-9-3-6-17-7-4-9/h2,5,8-9,14H,3-4,6-7H2,1H3,(H,12,13)
InChIKeyKIIGQOGZZLKOHH-UHFFFAOYSA-N
XLogP0.58
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.34
LogP ≤ 50.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-cyclobutyl-2-(methylamino)pyridine-4-sulfonamide
CID 62414070
2-(methylamino)-N-(6-oxopiperidin-3-yl)pyridine-4-sulfonamide
CID 63661990
2-(methylamino)-N-(7-oxabicyclo[2.2.1]heptan-2-yl)pyridine-4-sulfonamide
CID 80720100
N-methyl-2-(methylamino)pyridine-4-sulfonamide
CID 62148302
3,4-dichloro-N-(oxan-4-yl)benzenesulfonamide
CID 110726881
N-(2-ethylcyclohexyl)-2-(methylamino)pyridine-4-sulfonamide
CID 62153282
N-(1-azabicyclo[2.2.2]octan-3-yl)-2-(methylamino)pyridine-4-sulfonamide
CID 62143492
3-(methylamino)-4-nitro-N-(oxan-4-yl)benzenesulfonamide
CID 82845360
2-(methylamino)-N-(oxolan-2-ylmethyl)pyridine-4-sulfonamide
CID 55043942
3-chloro-4-methyl-N-(oxan-4-yl)benzenesulfonamide
CID 110726898
3-N-(oxan-4-yl)benzene-1,3-disulfonamide
CID 43610535
3-amino-N-(oxan-4-yl)benzenesulfonamide
CID 43609614

Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-N-(oxan-4-yl)pyridine-4-sulfonamide?
The IUPAC name of 2-(methylamino)-N-(oxan-4-yl)pyridine-4-sulfonamide (CID 62147724) is 2-(methylamino)-N-(oxan-4-yl)pyridine-4-sulfonamide.
What is the SMILES notation for 2-(methylamino)-N-(oxan-4-yl)pyridine-4-sulfonamide?
The canonical SMILES for 2-(methylamino)-N-(oxan-4-yl)pyridine-4-sulfonamide is CNc1cc(S(=O)(=O)NC2CCOCC2)ccn1.
What is the InChIKey of 2-(methylamino)-N-(oxan-4-yl)pyridine-4-sulfonamide?
The InChIKey is KIIGQOGZZLKOHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O3S/c1-12-11-8-10(2-5-13-11)18(15,16)14-9-3-6-17-7-4-9/h2,5,8-9,14H,3-4,6-7H2,1H3,(H,12,13).
What are the key properties of 2-(methylamino)-N-(oxan-4-yl)pyridine-4-sulfonamide?
2-(methylamino)-N-(oxan-4-yl)pyridine-4-sulfonamide has a molecular weight of 271.34 g/mol, XLogP of 0.58, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-N-(oxan-4-yl)pyridine-4-sulfonamide is sourced from PubChem (CID 62147724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).